COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.195  -1.241   0.184  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.661   0.036   0.298  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.499   1.136   0.347  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.884   0.957   0.281  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.411  -0.333   0.167  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.565  -1.421   0.119  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.782   2.121   0.333  1.00  0.00           C  
HETATM    8  C   UNL     1       0.346   0.303  -0.809  1.00  0.00           C  
HETATM    9  C   UNL     1       1.822   0.375  -0.821  1.00  0.00           C  
HETATM   10  C   UNL     1       2.536   0.334   0.378  1.00  0.00           C  
HETATM   11  C   UNL     1       3.914   0.401   0.359  1.00  0.00           C  
HETATM   12  C   UNL     1       4.589   0.507  -0.846  1.00  0.00           C  
HETATM   13  C   UNL     1       3.886   0.548  -2.037  1.00  0.00           C  
HETATM   14  C   UNL     1       2.509   0.477  -2.033  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.294  -2.414   0.127  1.00  0.00           N1+
HETATM   16  O   UNL     1      -1.760  -3.535   0.022  1.00  0.00           O1-
HETATM   17  O   UNL     1      -0.313   0.205   0.361  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.272   0.333  -1.854  1.00  0.00           O  
HETATM   19  O   UNL     1      -0.087  -2.259   0.184  1.00  0.00           O  
HETATM   20 CL   UNL     1       4.805   0.352   1.849  1.00  0.00          Cl  
HETATM   21  H   UNL     1      -2.085   2.129   0.436  1.00  0.00           H  
HETATM   22  H   UNL     1      -5.480  -0.478   0.115  1.00  0.00           H  
HETATM   23  H   UNL     1      -3.973  -2.417   0.031  1.00  0.00           H  
HETATM   24  H   UNL     1      -5.852   1.980   0.282  1.00  0.00           H  
HETATM   25  H   UNL     1       2.011   0.252   1.318  1.00  0.00           H  
HETATM   26  H   UNL     1       5.667   0.559  -0.856  1.00  0.00           H  
HETATM   27  H   UNL     1       4.418   0.632  -2.974  1.00  0.00           H  
HETATM   28  H   UNL     1       1.962   0.503  -2.964  1.00  0.00           H  
HETATM   29  O   UNL     1      -4.322   3.239   0.433  1.00  0.00           O  
CONECT    1   15    2    2    6                                       
CONECT    2   17    1    1    3                                       
CONECT    3    2    4    4   21                                       
CONECT    4    3    3    5    7                                       
CONECT    5    6    6    4   22                                       
CONECT    6    1    5    5   23                                       
CONECT    7    4   24   29   29                                       
CONECT    8   18   18   17    9                                       
CONECT    9   10    8   14   14                                       
CONECT   10   11   11    9   25                                       
CONECT   11   20   10   10   12                                       
CONECT   12   11   13   13   26                                       
CONECT   13   12   12   14   27                                       
CONECT   14    9    9   13   28                                       
CONECT   15   16   19   19    1                                       
CONECT   16   15                                                      
CONECT   17    8    2                                                 
CONECT   18    8    8                                                 
CONECT   19   15   15                                                 
CONECT   20   11                                                      
CONECT   21    3                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25   10                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29    7    7                                                 
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
